%chk=000182025.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182025

0 1
O 0.729248 0.631288 -0.240991
O 0.296555 0.312204 1.982412
O -2.207785 -2.557460 -1.126083
O -0.545660 -1.994696 0.138593
N -1.603216 -1.766865 -0.423761
C -1.507088 0.625930 0.373365
C -2.216950 -0.425756 -0.229724
C -2.127546 1.867034 0.546359
C -3.537714 -0.236414 -0.662235
C -0.096485 0.464395 0.860342
C 2.106736 0.340961 -0.136256
C -3.447793 2.054506 0.118969
C -4.149473 1.007090 -0.484801
C 2.539070 -0.909550 0.313171
C 2.969616 1.333739 -0.608316
C 3.911200 -1.168890 0.283185
C 4.337026 1.042777 -0.632361
C 4.805583 -0.198623 -0.187118
H -1.581708 2.689563 1.016070
H -4.076528 -1.065262 -1.138210
H -3.928373 3.025598 0.258449
H -5.177442 1.157475 -0.820660
H 1.820551 -1.649924 0.670173
H 2.581069 2.289141 -0.949985
H 4.284849 -2.133287 0.627582
H 5.039599 1.790988 -0.997989
H 5.872759 -0.412361 -0.205480


%chk=000182025-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182025

0 1
O 0.716957 0.521071 -0.279477
O 0.287537 0.631803 2.035676
O -1.879216 -2.143884 -1.875432
O -0.549017 -1.969128 -0.030163
N -1.483068 -1.536511 -0.810376
C -1.546800 0.656231 0.427426
C -2.179837 -0.282677 -0.424400
C -2.305073 1.760747 0.879298
C -3.509200 -0.116058 -0.863490
C -0.108389 0.561375 0.856894
C 2.124165 0.262304 -0.157326
C -3.642920 1.935579 0.460683
C -4.241262 1.004492 -0.420480
C 2.617680 -0.766830 0.670773
C 2.966596 1.030006 -0.984186
C 4.007338 -1.018607 0.668419
C 4.353871 0.762352 -0.976362
C 4.876971 -0.259024 -0.149187
H -1.832474 2.483552 1.551470
H -3.948801 -0.868420 -1.523836
H -4.214179 2.798112 0.818307
H -5.276583 1.140516 -0.747957
H 1.938415 -1.354520 1.292803
H 2.535326 1.810317 -1.618415
H 4.408265 -1.814856 1.304643
H 5.021011 1.349864 -1.616142
H 5.952787 -0.464206 -0.144463


